ChemSpider 2D Image | (3-(4-Bromophenyl)-1H-pyrazol-5-yl)methanol | C10H9BrN2O

(3-(4-Bromophenyl)-1H-pyrazol-5-yl)methanol

  • Molecular FormulaC10H9BrN2O
  • Average mass253.095 Da
  • Monoisotopic mass251.989822 Da
  • ChemSpider ID25526551

More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3-(4-Bromophenyl)-1H-pyrazol-5-yl)methanol
[3-(4-Bromophenyl)-1H-pyrazol-5-yl]methanol [ACD/IUPAC Name]
[3-(4-Bromophényl)-1H-pyrazol-5-yl]méthanol [French] [ACD/IUPAC Name]
[3-(4-Bromphenyl)-1H-pyrazol-5-yl]methanol [German] [ACD/IUPAC Name]
1137165-23-1 [RN]
1H-Pyrazole-5-methanol, 3-(4-bromophenyl)- [ACD/Index Name]
[1137165-23-1] [RN]
[5-(4-Bromo-phenyl)-1H-pyrazol-3-yl]-methanol
[5-(4-BROMOPHENYL)-2H-PYRAZOL-3-YL]METHANOL
1192020-75-9 [RN]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.6±0.1 g/cm3
    Boiling Point: 464.3±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 76.5±3.0 kJ/mol
    Flash Point: 234.6±25.9 °C
    Index of Refraction: 1.657
    Molar Refractivity: 57.5±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.95
    ACD/LogD (pH 5.5): 2.06
    ACD/BCF (pH 5.5): 21.61
    ACD/KOC (pH 5.5): 314.01
    ACD/LogD (pH 7.4): 2.06
    ACD/BCF (pH 7.4): 21.61
    ACD/KOC (pH 7.4): 314.05
    Polar Surface Area: 49 Å2
    Polarizability: 22.8±0.5 10-24cm3
    Surface Tension: 62.0±3.0 dyne/cm
    Molar Volume: 156.3±3.0 cm3

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